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Details of Heneicosanoic acid

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Role	Metabolite
MPIMP ID	M000876
stereoisomer
isotopomer	ambient
formula	C21H42O2
molecular mass	326.558
monoisotopic mass	326.31848
InChI	InChI=1S/C21H42O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21(22)23/h2-20H2,1H3,(H,22,23)
InChIKey	CKDDRHZIAZRDBW-UHFFFAOYSA-N
class
application/atom+xml	http://gmd.mpimp-golm.mpg.de/REST/gmd.svc/Metabolite(guid%27ba927389-7f05-42e2-ada5-59c0a171abb2%27)

Synonyms of Heneicosanoic acid

property	value
CAS	2363-71-5
ChEBI ID	ChEBI:39248
ChEBI ontology	is a long-chain fatty acid
ChEBI ontology	is a straight-chain saturated fatty acid
ChEBI ontology	is a very long-chain fatty acid
ChemSpider ID	16012
PubChem CID	16898
PubChem SID	24895676
PubChem SID	92297892
synonym	21:0
19 synonym(s)
Page of 2 Results per page:

Derivatives of Heneicosanoic acid

analyte	stereoisomer	isotopomer
Heneicosanoic acid (1TMS)		ambient
1 analyte(s)

Reference substances of Heneicosanoic acid

reference substance	supplier	supplier code	lot
Heneicosanoic acid	Sigma	H5149	96H8431
1 reference substance(s)

Isotopomers and stereoisomers of Heneicosanoic acid

metabolite	stereoisomer	isotopomer
no hits!

Quantitative Heneicosanoic acid Profile Data

Each graph visualises metabolite concentrations across a single metabolite profiling experiment. Each box plot represents relative (normalised) metabolite concentrations for single replica groups in the specific metabolite profiling experiment.

Name	Organism	Factor	Heatmap	Box plot	Variance	Anova F score
no metabolite profile(s) found.

Qualitative Heneicosanoic acid Profile Data

species
no qualitative metabolite profile data available!

compound timestamp information
deposited	at 8/29/2006 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
last changed	at 10/1/2012 by Hummel J., Max Planck Institute of Molecular Plant Physiology, Bioinformatics, Am Muehlenberg 1, D-14476 Golm, Germany
modified by users	Strehmel N., Hummel J.

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